methyl 2-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[4-(1,3-dithiolan-2-yl)phenyl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-4-methyl-pentanoate CAS Name: 2-[[[4-(1,3-dithiolan-2-yl)phenyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-4-methylpentanoate Traditional Name: 2-[[4-(1,3-dithiolan-2-yl)benzoyl]amino]-4-methyl-valeric acid methyl ester Formula: C17H23NO3S2 MolecularWeight: 353.49942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=CC=C(C=C1)C2SCCS2

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)C1=CC=C(C=C1)C2SCCS2

InChI

InChI=1S/C17H23NO3S2/c1-11(2)10-14(16(20)21-3)18-15(19)12-4-6-13(7-5-12)17-22-8-9-23-17/h4-7,11,14,17H,8-10H2,1-3H3,(H,18,19)